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3-(4-pyridinylmethyl)-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID DXjzGGbMQbL
InChI InChI=1S/C16H15N3OS2/c20-15-13-11-3-1-2-4-12(11)22-14(13)18-16(21)19(15)9-10-5-7-17-8-6-10/h5-8H,1-4,9H2,(H,18,21)
InChIKey MPQUAJSELKMCSK-UHFFFAOYSA-N
Mol Weight 329.44 g/mol
Molecular Formula C16H15N3OS2
Exact Mass 329.065654 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5cBQvLWOlWB
Name 3-(4-pyridinylmethyl)-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H15N3OS2/c20-15-13-11-3-1-2-4-12(11)22-14(13)18-16(21)19(15)9-10-5-7-17-8-6-10/h5-8H,1-4,9H2,(H,18,21)
InChIKey MPQUAJSELKMCSK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7868
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1268885; Labnumber: COL6294; UZI_ID: UZI-007870
Temperature 318 °C